[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(2,4-dichlorophenyl)-2-oxo-ethyl] 6-bromo-7-chloro-8-methyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 6-bromo-7-chloro-8-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-(2,4-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dichlorophenyl)-2-oxoethyl] 6-bromo-7-chloro-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-7-chloro-8-methyl-2-(p-tolyl)cinchoninic acid [2-(2,4-dichlorophenyl)-2-keto-ethyl] ester Formula: C26H17BrCl3NO3 MolecularWeight: 577.68108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3C(=C2)C(=O)OCC(=O)C4=C(C=C(C=C4)Cl)Cl)Br)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3C(=C2)C(=O)OCC(=O)C4=C(C=C(C=C4)Cl)Cl)Br)Cl)C

InChI

InChI=1S/C26H17BrCl3NO3/c1-13-3-5-15(6-4-13)22-11-19(18-10-20(27)24(30)14(2)25(18)31-22)26(33)34-12-23(32)17-8-7-16(28)9-21(17)29/h3-11H,12H2,1-2H3